tert-butyl 4-[[4-(phenylcarbamoyl)-1H-imidazol-5-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-(phenylcarbamoyl)-1H-imidazol-5-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-(phenylcarbamoyl)-1H-imidazole-5-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-[anilino(oxo)methyl]-1H-imidazol-5-yl]-oxomethyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-(phenylcarbamoyl)-1H-imidazole-5-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-(phenylcarbamoyl)-1H-imidazole-5-carbonyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C2=C(N=CN2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C2=C(N=CN2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H27N5O4/c1-21(2,3)30-20(29)26-11-9-15(10-12-26)25-19(28)17-16(22-13-23-17)18(27)24-14-7-5-4-6-8-14/h4-8,13,15H,9-12H2,1-3H3,(H,22,23)(H,24,27)(H,25,28)